dimethyl 5-[(1-phenylpiperidin-4-yl)carbonylamino]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[(1-phenylpiperidin-4-yl)carbonylamino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[(1-phenylpiperidine-4-carbonyl)amino]benzene-1,3-dicarboxylate CAS Name: 5-[[oxo-(1-phenyl-4-piperidinyl)methyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[(1-phenylpiperidine-4-carbonyl)amino]benzene-1,3-dicarboxylate Traditional Name: 5-[(1-phenylisonipecotoyl)amino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C22H24N2O5 MolecularWeight: 396.43636

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)NC(=O)C2CCN(CC2)C3=CC=CC=C3)C(=O)OC

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)NC(=O)C2CCN(CC2)C3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C22H24N2O5/c1-28-21(26)16-12-17(22(27)29-2)14-18(13-16)23-20(25)15-8-10-24(11-9-15)19-6-4-3-5-7-19/h3-7,12-15H,8-11H2,1-2H3,(H,23,25)